N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(4-cyano-2-phenyl-3-pyrazolyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(4-cyano-2-phenylpyrazol-3-yl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(4-cyano-2-phenyl-pyrazol-3-yl)-2-piperidin-1-ium-1-yl-acetamide Formula: C17H20N5O+ MolecularWeight: 310.3736

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=C(C=NN2C3=CC=CC=C3)C#N

InChI

InChI=1S/C17H19N5O/c18-11-14-12-19-22(15-7-3-1-4-8-15)17(14)20-16(23)13-21-9-5-2-6-10-21/h1,3-4,7-8,12H,2,5-6,9-10,13H2,(H,20,23)/p+1